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oleandomycin 2'-O-phosphate

PropertiesImage
MNX_IDMNXM4756 Image of MNXM4756
referencechebi:57607
formulaC35H61NO15P
global charge-1
mol weight766.839
InChIKeyXGECXLDCKVMKRN-KPBLUZLMSA-M
InChIInChI=1S/C35H62NO15P/c1-16-14-35(15-45-35)32(39)19(4)27(37)18(3)22(7)48-33(40)21(6)30(49-26-13-25(44-11)28(38)23(8)47-26)20(5)29(16)50-34-31(51-52(41,42)43)24(36(9)10)12-17(2)46-34/h16-31,34,37-38H,12-15H2,1-11H3,(H2,41,42,43)/p-1/t16-,17+,18-,19+,20+,21+,22+,23-,24-,25-,26-,27-,28-,29-,30-,31+,34-,35+/m0/s1
SMILESCO[C@H]1C[C@H](O[C@H]2[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@H]([NH+](C)C)[C@H]3OP(=O)([O-])[O-])[C@@H](C)C[C@@]3(CO3)C(=O)[C@H](C)[C@@H](O)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C35H62NO15P/c1-16-14-35(15-45-35)32(39)19(4)27(37)18(3)22(7)48-33(40)21(6)30(49-26-13-25(44-11)28(38)23(8)47-26)20(5)29(16)50-34-31(51-52(41,42)43)24(36(9)10)12-17(2)46-34/h16-31,34,37-38H,12-15H2,1-11H3,(H2,41,42,43)/t16-,17+,18-,19+,20+,21+,22+,23-,24-,25-,26-,27-,28-,29-,30-,31+,34-,35+/m0/s1 Image of MNXM4756
SMILES (mnx)[CH3:1][C@H:16]1[CH2:14][C@@:35]2([CH2:15][O:45]2)[C:32](=[O:39])[C@H:19]([CH3:4])[C@@H:27]([OH:37])[C@@H:18]([CH3:3])[C@@H:22]([CH3:7])[O:48][C:33](=[O:40])[C@H:21]([CH3:6])[C@@H:30]([O:49][C@H:26]2[CH2:13][C@H:25]([O:44][CH3:11])[C@@H:28]([OH:38])[C@H:23]([CH3:8])[O:47]2)[C@H:20]([CH3:5])[C@H:29]1[O:50][C@H:34]1[C@H:31]([O:51][P:52]([OH:41])([OH:42])=[O:43])[C@@H:24]([N:36]([CH3:9])[CH3:10])[CH2:12][C@@H:17]([CH3:2])[O:46]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:57607
chebi:57607
XGECXLDCKVMKRN-KPBLUZLMSA-M 		oleandomycin 2'-O-phosphate
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylazaniumyl)-2-O-phosphonato-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside
oleandomycin 2'-O-phosphate anion
oleandomycin 2'-O-phosphate(1-)

kegg.compound:C03796
keggC:C03796
XGECXLDCKVMKRN-KPBLUZLMSA-N 		Oleandomycin 2'-O-phosphate

seed.compound:cpd02377
seedM:cpd02377
XGECXLDCKVMKRN-KPBLUZLMSA-M 		Oleandomycin 2'-O-phosphate
oleandomycin 2'-O-phosphate

metacyc.compound:OLEANDOMYCIN-2-O-PHOSPHATE
metacycM:OLEANDOMYCIN-2-O-PHOSPHATE
XGECXLDCKVMKRN-KPBLUZLMSA-M 		oleandomycin 2'-O-phosphate

CHEBI:16021
chebi:16021
XGECXLDCKVMKRN-KPBLUZLMSA-N 		oleandomycin 2'-O-phosphate
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6-hydroxy-5,7,8,11,13,15-hexamethyl-4,10-dioxo-14-[3,4,6-trideoxy-3-(dimethylamino)-2-O-phosphono-beta-D-xylo-hexopyranosyloxy]-1,9-dioxaspiro[2.13]hexadec-12-yl 2,6-dideoxy-3-O-methyl-alpha-L-arabino-hexopyranoside
Oleandomycin 2'-O-phosphate

chebi:14683
chebi:25660
chebi:7738
keggC:M_C03796
seedM:M_cpd02377 		secondary/obsolete/fantasy identifier